SCHEMBL19782604

SCHEMBL19782604

COC(=S)c1cnc2c(Br)cc(C)cc2n1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.34
MAPT P10636 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
F2RL3 Q96RI0 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28941145 0.86 XDH (0.43) XDHMAPTSMN1; SMN2
SCHEMBL21395423 0.83 XDH (0.31) XDHF2RL3
SCHEMBL19783390 0.78 ALDH1A1 (0.34) XDHMAPTSMN1; SMN2
SCHEMBL19776433 0.75 ALDH1A1 (0.45) MAPTSMN1; SMN2
SCHEMBL19776431 0.74 F2RL3 (0.44) F2RL3
SCHEMBL9089178 0.73 NQO2 (0.38) F2RL3
SCHEMBL29481835 0.73 CCR1 (0.36) F2RL3
SCHEMBL19776270 0.72 F2RL3 (0.38) MAPTF2RL3
SCHEMBL21379355 0.70 KDM4E (0.43) XDHSMN1; SMN2F2RL3
SCHEMBL30189831 0.70 KDM4E (0.43) XDHSMN1; SMN2F2RL3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12060347-B2 Bicyclic heteroaryl substituted compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-13 US disclosed
CN-109689647-B Bicyclic heteroaryl substituted compounds 百时美施贵宝公司 2023-01-20 CN disclosed
WO-2018013774-A1 BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-01-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12060347-B2 Bicyclic heteroaryl substituted compounds F2, F2RL3, F12 XDH 370/4885MAPT 1155/4885SMN1; SMN2 3957/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.